4-[(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(3-oxo-2,4-dihydroquinoxalin-1-yl)methyl]thiazole-2-carboxylic acid CAS Name: 4-[(3-oxo-2,4-dihydroquinoxalin-1-yl)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(3-oxo-2,4-dihydroquinoxalin-1-yl)methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(3-keto-2,4-dihydroquinoxalin-1-yl)methyl]thiazole-2-carboxylic acid Formula: C13H11N3O3S MolecularWeight: 289.30974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CC=CC=C2N1CC3=CSC(=N3)C(=O)O

Isomeric SMILES

C1C(=O)NC2=CC=CC=C2N1CC3=CSC(=N3)C(=O)O

InChI

InChI=1S/C13H11N3O3S/c17-11-6-16(10-4-2-1-3-9(10)15-11)5-8-7-20-12(14-8)13(18)19/h1-4,7H,5-6H2,(H,15,17)(H,18,19)